2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide

C19H22N2O4 — CID 6872121

IUPAC2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide
SMILESCCCOc1ccccc1/C=N/NC(=O)COc1ccccc1OC
InChIInChI=1S/C19H22N2O4/c1-3-12-24-16-9-5-4-8-15(16)13-20-21-19(22)14-25-18-11-7-6-10-17(18)23-2/h4-11,13H,3,12,14H2,1-2H3,(H,21,22)/b20-13+
InChIKeySGTLQXFHSGTMOR-DEDYPNTBSA-N
MW342.40 g/mol
LogP3.01
Rot. Bonds9

About 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide

2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide (PubChem CID 6872121) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide
PubChem CID6872121
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide
SMILESCCCOc1ccccc1/C=N/NC(=O)COc1ccccc1OC
InChIInChI=1S/C19H22N2O4/c1-3-12-24-16-9-5-4-8-15(16)13-20-21-19(22)14-25-18-11-7-6-10-17(18)23-2/h4-11,13H,3,12,14H2,1-2H3,(H,21,22)/b20-13+
InChIKeySGTLQXFHSGTMOR-DEDYPNTBSA-N
XLogP3.01
TPSA69.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide (CID 6872121) is 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide is CCCOc1ccccc1/C=N/NC(=O)COc1ccccc1OC.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide?
The InChIKey is SGTLQXFHSGTMOR-DEDYPNTBSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-3-12-24-16-9-5-4-8-15(16)13-20-21-19(22)14-25-18-11-7-6-10-17(18)23-2/h4-11,13H,3,12,14H2,1-2H3,(H,21,22)/b20-13+.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide?
2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide has a molecular weight of 342.40 g/mol, XLogP of 3.01, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(E)-(2-propoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 6872121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).